SCHEMBL80667

SCHEMBL80667

COc1ccc(CCCBr)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.61
KDM4E B2RXH2 1/20 0.61
CA2 P00918 1/20 0.59
POLB P06746 1/20 0.58
CYP19A1 P11511 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2D6 P10635 1/20 0.58
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56
AOC3 Q16853 1/20 0.54
STAT3 P40763 1/20 0.53
MAPT P10636 1/20 0.51
EBP Q15125 2/20 0.50
SIGMAR1 Q99720 2/20 0.50
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50
TUBA4A P68366 1/20 0.50

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10411628 0.93 ATM (0.58) ATMKDM4ECA2POLBCYP19A1
SCHEMBL27200220 0.93 ATM (0.58) ATMKDM4ECA2POLBCYP19A1
SCHEMBL516206 0.88 ATM (0.66) ATMKDM4ECA2POLBCYP19A1
SCHEMBL30764700 0.88 ATM (0.66) ATMKDM4ECA2POLBCYP19A1
SCHEMBL10343404 0.88 ATM (0.70) ATMKDM4ECA2POLBCYP19A1
SCHEMBL30869991 0.88 ATM (0.70) ATMKDM4ECA2POLBCYP19A1
SCHEMBL23913120 0.86 ATM (0.68) ATMKDM4ECA2POLBCYP19A1
SCHEMBL31556187 0.86 ATM (0.68) ATMKDM4ECA2POLBCYP19A1
SCHEMBL31556190 0.86 ATM (0.68) ATMKDM4ECA2POLBCYP19A1
SCHEMBL17295274 0.85 ATM (0.44) ATMKDM4ECA2POLBCYP19A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 57 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4616906-A2 BENZO[A]PHENANTHRIDINE DERIVATIVES AS YAP/TAZ INHIBITORS Sanford Burnham Prebys Medical Discovery Institute (US) 2025-09-17 EP disclosed
US-20220267277-A1 DOPAMINE RECEPTOR D1 AGONISTS AND METHODS OF USE MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2022-08-25 US disclosed
EP-4003339-A2 DOPAMINE RECEPTOR D1 AGONISTS AND METHODS OF USE Sanford Burnham Prebys Medical Discovery Institute (US) 2022-06-01 EP disclosed
US-20220144888-A1 PEPTIDE PURIFICATION METHOD USING SULFONATE COMPOUND NAGASE & CO., LTD. (JP) 2022-05-12 US disclosed
WO-2021021953-A2 DOPAMINE RECEPTOR D1 AGONISTS AND METHODS OF USE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-02-04 WO disclosed
WO-2021021953-A2 DOPAMINE RECEPTOR D1 AGONISTS AND METHODS OF USE Sanford Burnham Prebys Medical Discovery Institute (US) 2021-02-04 WO disclosed
EP-2632889-B1 INTERMEDIATE COMPOUNDS AND PROCESS FOR THE PREPARATION OF FINGOLIMOD MAPI PHARMA LTD (IL) 2018-08-29 EP disclosed
WO-2016115360-A1 C-MYC LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2016-07-21 WO disclosed
WO-2016115360-A1 C-MYC LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2016-07-21 WO disclosed
EP-2168944-B1 AMINE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2016-05-11 EP disclosed
EP-0297733-A2 Pharmaceutical compositions comprising catecholic butanes BLOCK DRUG COMPANY, INC. (US) 1989-01-04 EP disclosed
EP-0290442-A1 PHARMACOLOGICALLY ACTIVE COMPOUNDS AND MIXTURES THEREOF, ORGANIC COMPOSITIONS AND METAL SALTS CHEMEX PHARMACEUTICALS, INC. (US) 1988-11-17 EP disclosed
EP-0288534-A1 COMPOSITIONS OF CATECHOLIC BUTANES WITH ZINC. CHEMEX PHARMACEUTICALS INC (US) 1988-11-02 EP disclosed
WO-1988003806-A1 PHARMACOLOGICALLY ACTIVE COMPOSITIONS OF CATECHOLIC BUTANES WITH ZINC CHEMEX PHARMACEUTICALS, INC. (US) 1988-06-02 WO disclosed
WO-1988003805-A1 PHARMACOLOGICALLY ACTIVE COMPOUNDS AND MIXTURES THEREOF, ORGANIC COMPOSITIONS AND METAL SALTS CHEMEX PHARMACEUTICALS, INC. (US) 1988-06-02 WO disclosed
WO-1988003026-A1 COMPOSITIONS OF CATECHOLIC BUTANES WITH ZINC CHEMEX PHARMACEUTICALS, INC. (US) 1988-05-05 WO disclosed
US-4733002-A Lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1988-03-22 US disclosed
US-4711895-A 4-hydroxy-2-cyclopentenone, process for production thereof, pharmaceutical composition comprising it TEIJIN LIMITED (JP) 1987-12-08 US disclosed
EP-0180399-A2 Anti-tumor 4-Hydroxy-2-cyclopentenones TEIJIN LIMITED (JP) 1986-05-07 EP disclosed
EP-0163270-A2 A lipoxygenase inhibitor GREEN CROSS CORPORATION (JP) 1985-12-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220267277-A1 DOPAMINE RECEPTOR D1 AGONISTS AND METHODS OF USE PRLHR, YAP1, MST1R ATM 1235/4885KDM4E 2956/4885CA2 4844/4885
US-20220144888-A1 PEPTIDE PURIFICATION METHOD USING SULFONATE COMPOUND VIP, IAPP, RPS27A ATM 3744/4885KDM4E 4477/4885CA2 1327/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.